(3-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: (3-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: (3-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (3-chlorophenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (3-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (3-chlorobenzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C13H17ClN3+ MolecularWeight: 250.74718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C[NH2+]CCCN2C=CN=C2

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C13H16ClN3/c14-13-4-1-3-12(9-13)10-15-5-2-7-17-8-6-16-11-17/h1,3-4,6,8-9,11,15H,2,5,7,10H2/p+1